methyl 4-[[2-(2-methylpropanoylamino)ethylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(2-methylpropanoylamino)ethylamino]methyl]benzoate Openeye Name: methyl 4-[[2-(2-methylpropanoylamino)ethylamino]methyl]benzoate CAS Name: 4-[[2-[(2-methyl-1-oxopropyl)amino]ethylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(2-methylpropanoylamino)ethylamino]methyl]benzoate Traditional Name: 4-[[2-(isobutyrylamino)ethylamino]methyl]benzoic acid methyl ester Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNCC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CC(C)C(=O)NCCNCC1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C15H22N2O3/c1-11(2)14(18)17-9-8-16-10-12-4-6-13(7-5-12)15(19)20-3/h4-7,11,16H,8-10H2,1-3H3,(H,17,18)